| Entry |
|
|---|
| Name |
Clobetasone (INN) |
|---|
| Formula |
C22H26ClFO4
|
|---|
| Exact mass |
408.1504
|
|---|
| Mol weight |
408.8908
|
|---|
| Structure |
|
|---|
| Simcomp |
|
|---|
| Class |
|
|---|
| Remark |
| Product (DG00411): | D01273<JP> |
|
|---|
| Efficacy |
Anti-inflammatory, Glucocorticoid receptor agonist |
|---|
| Target |
|
|---|
| Pathway |
| hsa04080 | Neuroactive ligand-receptor interaction |
|
|---|
| Interaction |
|
|---|
| Brite |
Anatomical Therapeutic Chemical (ATC) classification [BR:br08303]
D DERMATOLOGICALS
D07 CORTICOSTEROIDS, DERMATOLOGICAL PREPARATIONS
D07A CORTICOSTEROIDS, PLAIN
D07AB Corticosteroids, moderately potent (group II)
D07AB01 Clobetasone
D07717 Clobetasone (INN)
S SENSORY ORGANS
S01 OPHTHALMOLOGICALS
S01B ANTIINFLAMMATORY AGENTS
S01BA Corticosteroids, plain
S01BA09 Clobetasone
D07717 Clobetasone (INN)
Drug groups [BR:br08330]
Anti-inflammatory
DG01955 Corticosteroid
DG02068 Glucocorticoid
DG00411 Clobetasone
D07717 Clobetasone
Target-based classification of drugs [BR:br08310]
Nuclear receptors
Estrogen like receptors
3-Ketosteroid receptor
NR3C1 (GR)
D07717 Clobetasone (INN)
Drug groups [BR:br08330]
Anti-inflammatory
DG01955 Corticosteroid
DG02068 Glucocorticoid
DG00411 Clobetasone
|
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| Other DBs |
|
|---|
| KCF data |
ATOM 28
1 C1z C 25.2700 -17.2900
2 C1z C 24.1500 -17.9200
3 C1y C 26.4600 -17.9200
4 O1a O 26.4600 -16.5900
5 C5a C 25.2700 -15.8900
6 C1y C 24.1500 -19.3200
7 C1x C 22.9600 -17.2900
8 C1a C 24.1500 -16.5900
9 C1x C 26.4600 -19.3200
10 C1b C 26.4600 -15.1900
11 O5a O 24.0800 -15.2600
12 C1y C 22.9600 -19.9500
13 C5x C 21.7700 -17.9200
14 X Cl 26.4600 -13.8600
15 C1z C 21.7700 -19.3200
16 C1x C 22.9600 -21.2800
17 O5x O 20.6500 -17.2200
18 C1z C 20.6500 -19.9500
19 X F 21.7700 -20.6500
20 C1x C 21.7700 -21.9800
21 C2y C 20.6500 -21.3500
22 C2x C 19.4600 -19.3200
23 C1a C 20.5800 -18.6200
24 C2x C 19.4600 -21.9800
25 C2x C 18.2700 -19.9500
26 C5x C 18.2700 -21.3500
27 O5x O 17.0800 -21.9800
28 C1a C 27.8600 -17.9200
BOND 31
1 2 6 1
2 2 7 1
3 2 8 1 #Up
4 3 9 1
5 5 10 1
6 5 11 2
7 6 12 1
8 7 13 1
9 10 14 1
10 12 15 1
11 12 16 1
12 13 17 2
13 15 18 1
14 15 19 1 #Down
15 16 20 1
16 18 21 1
17 18 22 1
18 18 23 1 #Up
19 21 24 2
20 22 25 2
21 24 26 1
22 26 27 2
23 6 9 1
24 13 15 1
25 20 21 1
26 25 26 1
27 3 28 1 #Up
28 1 2 1
29 1 3 1
30 1 4 1 #Down
31 1 5 1 #Up
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|---|
